In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 17 | Yes |
Popular Name: [1-(4-Fluoro-phenyl)-ethyl]-piperidin-3-ylmethyl-amine hydrochloride [1-(4-Fluoro-phenyl)-ethyl]-pipe…
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CAS Number: 1185310-07-9
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Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.43 | 6.86 | -111.14 | 4 | 2 | 2 | 33 | 238.35 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.43 | 5.76 | -40.27 | 3 | 2 | 1 | 29 | 237.342 | 4 | ↓ |